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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@1102 f3b2605a-c512-4ea7-a41b-209d697bcdaa

This commit is contained in:
sjplimp 2007-10-25 22:51:46 +00:00
parent abb76ff98a
commit 9472ecf4a4
1 changed files with 1 additions and 3 deletions
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4
src/fix_deform.cpp
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@ -259,15 +259,14 @@ FixDeform::FixDeform(LAMMPS *lmp, int narg, char **arg) : Fix(lmp, narg, arg)
for (int i = 0; i < 3; i++) {
set[i].lo_initial = domain->boxlo[i];
set[i].hi_initial = domain->boxhi[i];
set[i].vol_initial = domain->xprd * domain->yprd * domain->zprd;
}
for (int i = 3; i < 6; i++) {
if (i == 5) set[i].tilt_initial = domain->xy;
else if (i == 4) set[i].tilt_initial = domain->xz;
else if (i == 3) set[i].tilt_initial = domain->yz;
set[i].vol_initial = domain->xprd * domain->yprd * domain->zprd;
}
// initial settings
// reneighboring only forced if flips will occur due to shape changes
if (set[3].style || set[4].style || set[5].style) force_reneighbor = 1;
@ -533,7 +532,6 @@ void FixDeform::end_of_step()
if (set[i].style != VOLUME) continue;
if (set[i].substyle == ONE_FROM_ONE) {
if (i == 1)
set[i].lo_target = 0.5*(set[i].lo_start+set[i].hi_start) -
0.5*(set[i].vol_start /
(set[set[i].dynamic1].hi_target -